化工社化工社 化学情報印刷レポート · 研究参考用
2-(モルホリノチオ)ベンゾチアゾール
2-(モルホリノチオ)ベンゾチアゾール · サントクールMOR · 4-[(ベンゾチアゾール-2-イル)チオ]モルホリン · (2-ベンゾチアゾリル)モルホリノスルフィド · モルホリノ(ベンゾチアゾール-2-イル)スルフィド · スルフェンアミドM · 2-(4-モルホリニルチオ)ベンゾチアゾール · アマックス
識別子と物理属性
| CAS No. | 102-77-2 |
|---|---|
| 分子式 | C11H12N2OS2 |
| 平均分子量 | 252.4 g/mol |
| 単同位体質量 | 252.039105 g/mol |
| SMILES | c1ccc2sc(SN3CCOCC3)nc2c1 |
| InChIKey | MHKLKWCYGIBEQF-UHFFFAOYSA-N |
| PubChem CID | 7619 |
| ChEMBL | CHEMBL1530581 |
| EC No. | 203-052-4 |
| DTXSID | DTXSID0021096 |
| 現地名 | 2-(モルホリノチオ)ベンゾチアゾール |
化学・物理的性質
| XLogP | 2.7 |
|---|---|
| 極性表面積 | 78.9 |
| 水素結合供与体数 | 0 |
| 水素結合受容体数 | 5 |
| 回転可能結合数 | 2 |
| 重原子数 | 16 |
| 形式電荷 | 0 |
| 複雑度 | 236 |
| Polymers | Plastics & Rubber -> Rubber Additives |
| SpringerMaterials Properties | Fusion temperature |
| 臭い | SWEET ODORブラウンにバフ。フレーク、甘い匂い |
| 密度 | 1.34 @ 25 °C1.34-1.40 |
| Color/Form | BUFF TO BROWN FLAKESTAN-COLORED POWDER |
| 溶解度 | INSOL IN WATER, SOL IN BENZENE, ACETONE, METHANOLアセトン（微量、加熱、超音波処理）、クロロホルム（微量） |
| 引火点 | 188 °C |
| Decomposition | WHEN HEATED TO DECOMPOSITION, IT EMITS HIGHLY TOXIC FUMES OF SO(X) & NO(X). |
| 融点 | 80 °C78-80°C |
| Food Contact Substances | FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR |
| Physical Description | Large CrystalsOther SolidDry PowderTan to brown solid with a sweet odor[HSDB] Pale granules or flakes[MSDSonline] |
| 沸点 | 413.1±55.0 °C(Predicted) |
| 蒸気圧 | 0.001Pa at 25℃ |
| 屈折率 | 1.5650 (estimate) |
| 貯蔵条件 | Sealed in dry,2-8°C |
| pKa（酸解離定数） | 1.05±0.10(Predicted) |
| 外観・状態 | 個体 |
| 色 | 白色～淡黄色 |
| 由来生物 | rabbit |
| LogP（分配係数） | 3.4 at 25℃ and pH7 |
| CAS データベース | 102-77-2(CAS DataBase Reference) |
| NISTの化学物質情報 | Morpholine, 4-(2-benzothiazolylthio)-(102-77-2) |
| EPAの化学物質情報 | Benzothiazole, 2-(4-morpholinylthio)- (102-77-2) |
化学的特性
Buff to brown flakes; sweet odor. Insoluble in water; solublein benzene, acetone, methanol.
安全性と法規制
| GHS 分類 | WarningH315: Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P272, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P333+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
|---|---|
| 規制情報 | Chemical: Morpholine, 4-(2-benzothiazolylthio)-Benzothiazole, 2-(4-morpholinylthio)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzothiazole, 2-(4-morpholinylthio)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)REACH registered substance: 2-(morpholinothio)benzothiazole (EC: 203-052-4)2-Benzothiazolylsulfenyl morpholine: Does not have an individual approval but may be used under an appropriate group standard |
| 有害性の概要 | May cause skin sensitization[CHEMINFO] Danger of skin sensitization[MAK] A skin and eye irritant[eChemPortal: ESIS] A mild skin and eye irritant[MSDSonline] It causes delayed-type skin sensitizationA case of immediate-type hypersensitivity was reported in a dental assistant[Kanerva, p. 1818] See Mercaptobenzothiazole. |
| Hazard Classes and Categories | Skin Irrit. 2 (100%)Eye irritation - category 2Serious eye damage/eye irritation - Category 2 |
| 保管条件 | MATERIALS WHICH ARE TOXIC AS STORED OR WHICH CAN DECOMPOSE INTO TOXIC COMPONENTS...SHOULD BE STORED IN A COOL WELL-VENTILATED PLACE, OUT OF DIRECT RAYS OF THE SUN, AWAY FROM AREAS OF HIGH FIRE HAZARD, AND SHOULD BE PERIODICALLY INSPECTED... INCOMPATIBLE MATERIALS SHOULD BE ISOLATED... |
| 処分方法 | SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices. |
| 有害作用 | Skin Sensitizer - An agent that can induce an allergic reaction in the skin. |
用途
用途
有機ゴム薬品(加硫促進剤)。
用途
ゴムの加硫促進剤
説明
This rubber vulcanization accelerator is used as a chemical in the rubber industry, especially in the production of synthetic rubber articles. Is contained in the "mercapto mix". As a corrosion inhibitor, it can be found in cutting fluids or in releasing fluids in the pottery industry. It induces mainly delayed-type hypersensitivity, but a case of immediate-type hypersensitivity was reported in a dental assistant.
使用
Delayed-action vulcanization accelerator.